(E)-2-(1H-benzimidazol-2-yl)-3-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)prop-2-enenitrile

Systemtic Name: (E)-2-(1H-benzimidazol-2-yl)-3-(5-chloranyl-3-methyl-1-phenyl-pyrazol-4-yl)prop-2-enenitrile Openeye Name: (E)-2-(1H-benzimidazol-2-yl)-3-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)prop-2-enenitrile CAS Name: (E)-2-(1H-benzimidazol-2-yl)-3-(5-chloro-3-methyl-1-phenyl-4-pyrazolyl)-2-propenenitrile IUPAC Name: (E)-2-(1H-benzimidazol-2-yl)-3-(5-chloro-3-methyl-1-phenylpyrazol-4-yl)prop-2-enenitrile Traditional Name: (E)-2-(1H-benzimidazol-2-yl)-3-(5-chloro-3-methyl-1-phenyl-pyrazol-4-yl)acrylonitrile Formula: C20H14ClN5 MolecularWeight: 359.81166

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C(=C1C=C(C#N)C2=NC3=CC=CC=C3N2)Cl)C4=CC=CC=C4

Isomeric SMILES

CC1=NN(C(=C1/C=C(\C#N)/C2=NC3=CC=CC=C3N2)Cl)C4=CC=CC=C4

InChI

InChI=1S/C20H14ClN5/c1-13-16(19(21)26(25-13)15-7-3-2-4-8-15)11-14(12-22)20-23-17-9-5-6-10-18(17)24-20/h2-11H,1H3,(H,23,24)/b14-11+